SCHEMBL15036019

SCHEMBL15036019

O=c1c(-c2cc(S(=O)(=O)c3ccccc3)cs2)cc2cnc(Nc3ccc(C4CCNCC4)cc3)nc2n1CC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.43
BRD4 O60885 3/20 0.43
JAK3 P52333 2/20 0.43
JAK1 P23458 1/20 0.43
BRD2 P25440 1/20 0.43
BRD3 Q15059 1/20 0.43
BRDT Q58F21 1/20 0.43
PTK2 Q05397 3/20 0.41
FLT4 P35916 4/20 0.40
WEE1 P30291 2/20 0.39
FGFR1 P11362 2/20 0.38
FGFR4 P22455 1/20 0.38
KDR P35968 1/20 0.38
EGFR P00533 1/20 0.38
CDK4 P11802 1/20 0.38
CDK6 Q00534 1/20 0.38
PAK4 O96013 1/20 0.38
PKN1 Q16512 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15041718 0.78 PAK3 (0.35) JAK3FGFR1FGFR4CDK4PAK4
SCHEMBL13553693 0.76 FGFR1 (0.42) JAK2BRD4JAK3JAK1BRD2
SCHEMBL15035740 0.74 RIPK2 (0.43) JAK2BRD4JAK3JAK1BRD2
SCHEMBL15041723 0.73 FGFR1 (0.47) PTK2WEE1FGFR1EGFRPAK4
SCHEMBL15035971 0.73 JAK2 (0.44) JAK2BRD4JAK3JAK1BRD2
SCHEMBL15036108 0.72 PAK1 (0.39) PTK2WEE1FGFR1FGFR4CDK4
SCHEMBL13553662 0.72 PKN1 (0.47) WEE1FGFR1FGFR4KDREGFR
SCHEMBL15041272 0.72 PKN1 (0.47) WEE1FGFR1FGFR4KDREGFR
SCHEMBL16309201 0.72 CAMK2D (0.44) JAK3WEE1FGFR1
SCHEMBL15036155 0.71 JAK2 (0.48) JAK2BRD4JAK3JAK1BRD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 US disclosed
US-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 US disclosed
US-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 US disclosed
US-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 US disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 US disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK3 JAK2 288/4885BRD4 489/4885JAK3 460/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 JAK2 720/4885BRD4 1003/4885JAK3 1901/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.